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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C18705
pubchemid 124489379
name Butroxydim
formula C24H33NO4
structure
Isomeric_Smiles CC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[C@@H](C2)CNC
Cannoical_Smiles CC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCC(C2)CNC
Gotenzyme_Smiles CCCC(=O)c1c(C)cc(C)c(C2CC(=O)C(/C(CC)=N/OCC)=C(O)C2)c1C